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CHEBI:201650 - 6beta-(Hexa-2,4-dienoyloxy)-9alpha,12-dihydroxydrimenol

ChEBI IDCHEBI:201650
ChEBI Name6beta-(Hexa-2,4-dienoyloxy)-9alpha,12-dihydroxydrimenol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H32O5
Net Charge0
Average Mass364.482
Monoisotopic Mass364.22497
SMILESCC=CC=CC(=O)OC1C=C(CO)C(O)(CO)C2(C)CCCC(C)(C)C12
InChIInChI=1S/C21H32O5/c1-5-6-7-9-17(24)26-16-12-15(13-22)21(25,14-23)20(4)11-8-10-19(2,3)18(16)20/h5-7,9,12,16,18,22-23,25H,8,10-11,13-14H2,1-4H3
InChIKeyFABFALSQMFMAOA-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
6beta-(Hexa-2,4-dienoyloxy)-9alpha,12-dihydroxydrimenol (CHEBI:201650) is a fatty acid ester (CHEBI:35748)
IUPAC Name 
[(1R,4S,4aS,8aS)-4-hydroxy-3,4-bis(hydroxymethyl)-4a,8,8-trimethyl-5,6,7,8a-tetrahydro-1H-naphthalen-1-yl] (2E,4E)-hexa-2,4-dienoate
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22842412ChemSpider